SpectraBase Compound ID | 8ENIIfRczG4 |
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InChI | InChI=1S/C9H8Cl2O2/c10-7-2-1-3-8(11)9(7)13-5-6-4-12-6/h1-3,6H,4-5H2 |
InChIKey | VOYMDUMUZXIMNN-UHFFFAOYSA-N |
Mol Weight | 219.07 g/mol |
Molecular Formula | C9H8Cl2O2 |
Exact Mass | 217.990135 g/mol |
SpectraBase Spectrum ID | 17kel2H5hZN |
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Name | 1-(2,6-Dichlorophenoxy)-2,3-epoxypropane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 217.990134896 u |
Formula | C9H8Cl2O2 |
InChI | InChI=1S/C9H8Cl2O2/c10-7-2-1-3-8(11)9(7)13-5-6-4-12-6/h1-3,6H,4-5H2 |
InChIKey | VOYMDUMUZXIMNN-UHFFFAOYSA-N |
Molecular Weight | 219.067 g/mol |
SMILES | C1=C(C(=C(C=C1)Cl)OCC1OC1)Cl |
Spectrum/Structure Validation Score (Raman) | 0.917457 |